The structural properties of transition metal hydrogen complexes in silicon
Author/Authors :
Resende، نويسنده , , A. and Jones، نويسنده , , R. and ضberg، نويسنده , , S. and Briddon، نويسنده , , P.R.، نويسنده ,
Pages :
3
From page :
146
To page :
148
Abstract :
A first-principles spin-polarised local density functional cluster method is used to explore the structural and vibrational properties of several substitutional transition-metal impurities complexed with hydrogen.
Keywords :
Ab initio theory , Transition-metal impurities , SI , H
